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100376-53-2 | Benzeneethanol, 2-amino-6-chloro-
CAS No: 100376-53-2 Catalog No: AG0001TK MDL No:MFCD00239021
Product Description
Catalog Number:
AG0001TK
Chemical Name:
Benzeneethanol, 2-amino-6-chloro-
CAS Number:
100376-53-2
Molecular Formula:
C8H10ClNO
Molecular Weight:
171.6241
MDL Number:
MFCD00239021
IUPAC Name:
2-(2-amino-6-chlorophenyl)ethanol
InChI:
InChI=1S/C8H10ClNO/c9-7-2-1-3-8(10)6(7)4-5-11/h1-3,11H,4-5,10H2
InChI Key:
PVBOKNRVNJCKRR-UHFFFAOYSA-N
SMILES:
OCCc1c(N)cccc1Cl
Properties
Complexity:
121
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.045g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
171.624g/mol
Monoisotopic Mass:
171.045g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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